N-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[5-methyl-2-(2-pyridinyl)-1H-indol-3-yl]butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butyramide Formula: C25H22N4OS MolecularWeight: 426.53338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)NC3=NC4=CC=CC=C4S3)C5=CC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)NC3=NC4=CC=CC=C4S3)C5=CC=CC=N5

InChI

InChI=1S/C25H22N4OS/c1-16-12-13-19-18(15-16)17(24(27-19)21-9-4-5-14-26-21)7-6-11-23(30)29-25-28-20-8-2-3-10-22(20)31-25/h2-5,8-10,12-15,27H,6-7,11H2,1H3,(H,28,29,30)