3-methyl-4-(2-methylpropyl)-1,1-bis(oxidanylidene)-N-phenethyl-1$l^{6},2,4-benzothiadiazine-7-carboxamide

Systemtic Name: 3-methyl-4-(2-methylpropyl)-1,1-bis(oxidanylidene)-N-phenethyl-1$l^{6},2,4-benzothiadiazine-7-carboxamide Openeye Name: 4-isobutyl-3-methyl-1,1-dioxo-N-phenethyl-1$l^{6},2,4-benzothiadiazine-7-carboxamide CAS Name: 3-methyl-4-(2-methylpropyl)-1,1-dioxo-N-phenethyl-1$l^{6},2,4-benzothiadiazine-7-carboxamide IUPAC Name: 3-methyl-4-(2-methylpropyl)-1,1-dioxo-N-phenethyl-1$l^{6},2,4-benzothiadiazine-7-carboxamide Traditional Name: 4-isobutyl-1,1-diketo-3-methyl-N-phenethyl-1$l^{6},2,4-benzothiadiazine-7-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NS(=O)(=O)C2=C(N1CC(C)C)C=CC(=C2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=NS(=O)(=O)C2=C(N1CC(C)C)C=CC(=C2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3S/c1-15(2)14-24-16(3)23-28(26,27)20-13-18(9-10-19(20)24)21(25)22-12-11-17-7-5-4-6-8-17/h4-10,13,15H,11-12,14H2,1-3H3,(H,22,25)