4-(2-azanyl-1-cyclopropyl-1-oxidanyl-2-oxidanylidene-ethyl)-N-(2-azanyl-5-thiophen-2-yl-phenyl)benzamide

Systemtic Name: 4-(2-azanyl-1-cyclopropyl-1-oxidanyl-2-oxidanylidene-ethyl)-N-(2-azanyl-5-thiophen-2-yl-phenyl)benzamide Openeye Name: 4-(2-amino-1-cyclopropyl-1-hydroxy-2-oxo-ethyl)-N-[2-amino-5-(2-thienyl)phenyl]benzamide CAS Name: 4-(2-amino-1-cyclopropyl-1-hydroxy-2-oxoethyl)-N-(2-amino-5-thiophen-2-ylphenyl)benzamide IUPAC Name: 4-(2-amino-1-cyclopropyl-1-hydroxy-2-oxoethyl)-N-(2-amino-5-thiophen-2-ylphenyl)benzamide Traditional Name: 4-(2-amino-1-cyclopropyl-1-hydroxy-2-keto-ethyl)-N-[2-amino-5-(2-thienyl)phenyl]benzamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N)(C(=O)N)O

Isomeric SMILES

C1CC1C(C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N)(C(=O)N)O

InChI

InChI=1S/C22H21N3O3S/c23-17-10-5-14(19-2-1-11-29-19)12-18(17)25-20(26)13-3-6-15(7-4-13)22(28,21(24)27)16-8-9-16/h1-7,10-12,16,28H,8-9,23H2,(H2,24,27)(H,25,26)