N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-4-(1H-benzimidazol-2-ylsulfanyl)butanamide

Systemtic Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-4-(1H-benzimidazol-2-ylsulfanyl)butanamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-4-(1H-benzimidazol-2-ylsulfanyl)butanamide CAS Name: N-[4-[5-(acetamidomethyl)-2-thiophenyl]-2-thiazolyl]-4-(1H-benzimidazol-2-ylthio)butanamide IUPAC Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-4-(1H-benzimidazol-2-ylsulfanyl)butanamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-4-(1H-benzimidazol-2-ylthio)butyramide Formula: C21H21N5O2S3 MolecularWeight: 471.61874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)CCCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)CCCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O2S3/c1-13(27)22-11-14-8-9-18(31-14)17-12-30-21(25-17)26-19(28)7-4-10-29-20-23-15-5-2-3-6-16(15)24-20/h2-3,5-6,8-9,12H,4,7,10-11H2,1H3,(H,22,27)(H,23,24)(H,25,26,28)