cyclopentyl (2S)-2-[[3-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]phenyl]methylamino]propanoate

Systemtic Name: cyclopentyl (2S)-2-[[3-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]phenyl]methylamino]propanoate Openeye Name: cyclopentyl (2S)-2-[[3-(4-carbamoyl-5-ureido-2-thienyl)phenyl]methylamino]propanoate CAS Name: (2S)-2-[[3-[4-carbamoyl-5-(carbamoylamino)-2-thiophenyl]phenyl]methylamino]propanoic acid cyclopentyl ester IUPAC Name: cyclopentyl (2S)-2-[[3-[4-carbamoyl-5-(carbamoylamino)thiophen-2-yl]phenyl]methylamino]propanoate Traditional Name: (2S)-2-[[3-(4-carbamoyl-5-ureido-2-thienyl)benzyl]amino]propionic acid cyclopentyl ester Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCC1)NCC2=CC=CC(=C2)C3=CC(=C(S3)NC(=O)N)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)OC1CCCC1)NCC2=CC=CC(=C2)C3=CC(=C(S3)NC(=O)N)C(=O)N

InChI

InChI=1S/C21H26N4O4S/c1-12(20(27)29-15-7-2-3-8-15)24-11-13-5-4-6-14(9-13)17-10-16(18(22)26)19(30-17)25-21(23)28/h4-6,9-10,12,15,24H,2-3,7-8,11H2,1H3,(H2,22,26)(H3,23,25,28)/t12-/m0/s1