N-(1,3-benzothiazol-2-ylmethyl)-1-(2-dimethylaminoethyl)-6-methyl-4-oxidanylidene-2-phenethyl-pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-dimethylaminoethyl)-6-methyl-4-oxidanylidene-2-phenethyl-pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-dimethylaminoethyl)-6-methyl-4-oxo-2-phenethyl-pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-dimethylaminoethyl)-6-methyl-4-oxo-2-phenethyl-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-dimethylaminoethyl)-6-methyl-4-oxo-2-phenethylpyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-dimethylaminoethyl)-4-keto-6-methyl-2-phenethyl-nicotinamide Formula: C27H30N4O2S MolecularWeight: 474.6177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CCN(C)C)CCC2=CC=CC=C2)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=O)C(=C(N1CCN(C)C)CCC2=CC=CC=C2)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C27H30N4O2S/c1-19-17-23(32)26(27(33)28-18-25-29-21-11-7-8-12-24(21)34-25)22(31(19)16-15-30(2)3)14-13-20-9-5-4-6-10-20/h4-12,17H,13-16,18H2,1-3H3,(H,28,33)