(1-methylindol-3-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (1-methylindol-3-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (1-methylindol-3-yl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (1-methyl-3-indolyl)-[4-(2-thiazolylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (1-methylindol-3-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (1-methylindol-3-yl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)N3CCCN(CC3)CC4=NC=CS4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)N3CCCN(CC3)CC4=NC=CS4

InChI

InChI=1S/C19H22N4OS/c1-21-13-16(15-5-2-3-6-17(15)21)19(24)23-9-4-8-22(10-11-23)14-18-20-7-12-25-18/h2-3,5-7,12-13H,4,8-11,14H2,1H3