[(3R)-4,4-dimethyl-1-[(2-pyrazin-2-yl-1,3-thiazol-4-yl)carbonyl]pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate

Systemtic Name: [(3R)-4,4-dimethyl-1-[(2-pyrazin-2-yl-1,3-thiazol-4-yl)carbonyl]pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Openeye Name: [(3R)-4,4-dimethyl-1-(2-pyrazin-2-ylthiazole-4-carbonyl)pyrrolidin-3-yl] N-[(1S)-1-[2-oxo-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamate CAS Name: N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamic acid [(3R)-4,4-dimethyl-1-[oxo-[2-(2-pyrazinyl)-4-thiazolyl]methyl]-3-pyrrolidinyl] ester IUPAC Name: [(3R)-4,4-dimethyl-1-(2-pyrazin-2-yl-1,3-thiazole-4-carbonyl)pyrrolidin-3-yl] N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Traditional Name: N-[(1S)-1-[2-keto-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamic acid [(3R)-4,4-dimethyl-1-(2-pyrazin-2-ylthiazole-4-carbonyl)pyrrolidin-3-yl] ester Formula: C30H36N6O5S MolecularWeight: 592.70904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=O)NC(C)C1=CC=CC=C1)NC(=O)OC2CN(CC2(C)C)C(=O)C3=CSC(=N3)C4=NC=CN=C4

Isomeric SMILES

CCCC[C@@H](C(=O)C(=O)N[C@H](C)C1=CC=CC=C1)NC(=O)O[C@H]2CN(CC2(C)C)C(=O)C3=CSC(=N3)C4=NC=CN=C4

InChI

InChI=1S/C30H36N6O5S/c1-5-6-12-21(25(37)26(38)33-19(2)20-10-8-7-9-11-20)35-29(40)41-24-16-36(18-30(24,3)4)28(39)23-17-42-27(34-23)22-15-31-13-14-32-22/h7-11,13-15,17,19,21,24H,5-6,12,16,18H2,1-4H3,(H,33,38)(H,35,40)/t19-,21+,24+/m1/s1