N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]phenothiazine-10-carboxamide

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]phenothiazine-10-carboxamide Openeye Name: N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]phenothiazine-10-carboxamide CAS Name: N-[2-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]phenyl]-10-phenothiazinecarboxamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]phenothiazine-10-carboxamide Traditional Name: N-[2-(homoveratrylcarbamoyl)phenyl]phenothiazine-10-carboxamide Formula: C30H27N3O4S MolecularWeight: 525.61808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)OC

InChI

InChI=1S/C30H27N3O4S/c1-36-25-16-15-20(19-26(25)37-2)17-18-31-29(34)21-9-3-4-10-22(21)32-30(35)33-23-11-5-7-13-27(23)38-28-14-8-6-12-24(28)33/h3-16,19H,17-18H2,1-2H3,(H,31,34)(H,32,35)