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

Systemtic Name: methyl N-[6-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[6-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[[4-(pivaloylamino)phenyl]thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O3S/c1-20(2,3)17(25)21-12-5-7-13(8-6-12)28-14-9-10-15-16(11-14)23-18(22-15)24-19(26)27-4/h5-11H,1-4H3,(H,21,25)(H2,22,23,24,26)