3-(azepan-1-ylsulfonyl)-4-methoxy-N-prop-2-enyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-prop-2-enyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-allyl-3-(azepan-1-ylsulfonyl)-4-methoxy-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-prop-2-enyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-prop-2-enyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-allyl-3-(azepan-1-ylsulfonyl)-4-methoxy-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Formula: C24H31N3O4S2 MolecularWeight: 489.65064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC=C)C2=NC3=C(S2)CCCC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC=C)C2=NC3=C(S2)CCCC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H31N3O4S2/c1-3-14-27(24-25-19-10-6-7-11-21(19)32-24)23(28)18-12-13-20(31-2)22(17-18)33(29,30)26-15-8-4-5-9-16-26/h3,12-13,17H,1,4-11,14-16H2,2H3