N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-3-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-3-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C)CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C)CC2OC(=C1)O

InChI

InChI=1S/C22H27N3O5S/c1-15-12-21(26)30-20-14-17(6-7-19(15)20)23-22(27)16-4-3-5-18(13-16)31(28,29)25-10-8-24(2)9-11-25/h3-5,12-13,20,26H,6-11,14H2,1-2H3