[3-methoxy-5-[4-[(2-methoxy-4,5-dimethyl-cyclohexa-2,4-dien-1-yl)amino]piperazin-1-yl]phenyl] methylsulfanylmethanoate

Systemtic Name: [3-methoxy-5-[4-[(2-methoxy-4,5-dimethyl-cyclohexa-2,4-dien-1-yl)amino]piperazin-1-yl]phenyl] methylsulfanylmethanoate Openeye Name: [3-methoxy-5-[4-[(2-methoxy-4,5-dimethyl-cyclohexa-2,4-dien-1-yl)amino]piperazin-1-yl]phenyl] methylsulfanylformate CAS Name: (methylthio)formic acid [3-methoxy-5-[4-[(2-methoxy-4,5-dimethyl-1-cyclohexa-2,4-dienyl)amino]-1-piperazinyl]phenyl] ester IUPAC Name: [3-methoxy-5-[4-[(2-methoxy-4,5-dimethylcyclohexa-2,4-dien-1-yl)amino]piperazin-1-yl]phenyl] methylsulfanylformate Traditional Name: (methylthio)formic acid [3-methoxy-5-[4-[(2-methoxy-4,5-dimethyl-cyclohexa-2,4-dien-1-yl)amino]piperazino]phenyl] ester Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(C1)NN2CCN(CC2)C3=CC(=CC(=C3)OC)OC(=O)SC)OC)C

Isomeric SMILES

CC1=C(C=C(C(C1)NN2CCN(CC2)C3=CC(=CC(=C3)OC)OC(=O)SC)OC)C

InChI

InChI=1S/C22H31N3O4S/c1-15-10-20(21(28-4)11-16(15)2)23-25-8-6-24(7-9-25)17-12-18(27-3)14-19(13-17)29-22(26)30-5/h11-14,20,23H,6-10H2,1-5H3