(3S)-5-[[(6S)-3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[[(6S)-3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-[[(6S)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-[[(6S)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-[[(6S)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-[[(6S)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-5-keto-3-methyl-valerate Formula: C18H25N2O4S- MolecularWeight: 365.4671

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CC(C)CC(=O)[O-]

Isomeric SMILES

CCC[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C[C@H](C)CC(=O)[O-]

InChI

InChI=1S/C18H26N2O4S/c1-3-4-11-5-6-12-13(9-11)25-18(16(12)17(19)24)20-14(21)7-10(2)8-15(22)23/h10-11H,3-9H2,1-2H3,(H2,19,24)(H,20,21)(H,22,23)/p-1/t10-,11-/m0/s1