5-methyl-1,1-bis(oxidanylidene)-N-pyridin-4-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepine-8-carboxamide

Systemtic Name: 5-methyl-1,1-bis(oxidanylidene)-N-pyridin-4-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepine-8-carboxamide Openeye Name: 5-methyl-1,1-dioxo-N-(4-pyridyl)-2,3,4,5-tetrahydro-1$l^{6}-benzothiepine-8-carboxamide CAS Name: 5-methyl-1,1-dioxo-N-pyridin-4-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-8-carboxamide IUPAC Name: 5-methyl-1,1-dioxo-N-pyridin-4-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepine-8-carboxamide Traditional Name: 1,1-diketo-5-methyl-N-(4-pyridyl)-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-8-carboxamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCS(=O)(=O)C2=C1C=CC(=C2)C(=O)NC3=CC=NC=C3

Isomeric SMILES

CC1CCCS(=O)(=O)C2=C1C=CC(=C2)C(=O)NC3=CC=NC=C3

InChI

InChI=1S/C17H18N2O3S/c1-12-3-2-10-23(21,22)16-11-13(4-5-15(12)16)17(20)19-14-6-8-18-9-7-14/h4-9,11-12H,2-3,10H2,1H3,(H,18,19,20)