N-(aminomethyl)-1,1-bis(oxidanylidene)-N-phenyl-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide

Systemtic Name: N-(aminomethyl)-1,1-bis(oxidanylidene)-N-phenyl-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide Openeye Name: N-(aminomethyl)-1,1-dioxo-N-phenyl-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide CAS Name: N-(aminomethyl)-1,1-dioxo-N-phenyl-2,3-dihydro-1$l^{6}-benzothiepin-4-carboxamide IUPAC Name: N-(aminomethyl)-1,1-dioxo-N-phenyl-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide Traditional Name: N-(aminomethyl)-1,1-diketo-N-phenyl-2,3-dihydro-1$l^{6}-benzothiepin-4-carboxamide Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)C2=CC=CC=C2C=C1C(=O)N(CN)C3=CC=CC=C3

Isomeric SMILES

C1CS(=O)(=O)C2=CC=CC=C2C=C1C(=O)N(CN)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3S/c19-13-20(16-7-2-1-3-8-16)18(21)15-10-11-24(22,23)17-9-5-4-6-14(17)12-15/h1-9,12H,10-11,13,19H2