N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(3-methyl-1,1-dioxo-thiolan-3-yl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(3-methyl-1,1-dioxothiolan-3-yl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C17H17N3O3S2/c1-17(6-9-25(22,23)11-17)19-15(21)12-4-5-13-14(10-12)24-16(18-13)20-7-2-3-8-20/h2-5,7-8,10H,6,9,11H2,1H3,(H,19,21)