methyl N-[6-[4-(butanoylamino)phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate

Systemtic Name: methyl N-[6-[4-(butanoylamino)phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-[4-(butanoylamino)phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[[4-(1-oxobutylamino)phenyl]thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[6-[4-(butanoylamino)phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[(4-butyramidophenyl)thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)SC2=CC3=C(C=C2)N=C(N3)NC(=O)OC

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)SC2=CC3=C(C=C2)N=C(N3)NC(=O)OC

InChI

InChI=1S/C19H20N4O3S/c1-3-4-17(24)20-12-5-7-13(8-6-12)27-14-9-10-15-16(11-14)22-18(21-15)23-19(25)26-2/h5-11H,3-4H2,1-2H3,(H,20,24)(H2,21,22,23,25)