N-[[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonylphenyl]methyl]ethanamide

Systemtic Name: N-[[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonylphenyl]methyl]ethanamide Openeye Name: N-[[4-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]phenyl]methyl]acetamide CAS Name: N-[[4-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]phenyl]methyl]acetamide IUPAC Name: N-[[4-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]phenyl]methyl]acetamide Traditional Name: N-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]benzyl]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N3O2S/c1-14(25)22-13-15-8-10-16(11-9-15)21(26)24-12-4-6-18(24)20-23-17-5-2-3-7-19(17)27-20/h2-3,5,7-11,18H,4,6,12-13H2,1H3,(H,22,25)