N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-[3-(4-ethyl-1-piperazinyl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-[3-(4-ethylpiperazino)propyl]-1-keto-6,7-dimethoxy-2-methyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C26H36N4O4S MolecularWeight: 500.65344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCNC(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=CS4

Isomeric SMILES

CCN1CCN(CC1)CCCNC(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=CS4

InChI

InChI=1S/C26H36N4O4S/c1-5-29-11-13-30(14-12-29)10-7-9-27-25(31)23-18-16-20(33-3)21(34-4)17-19(18)26(32)28(2)24(23)22-8-6-15-35-22/h6,8,15-17,23-24H,5,7,9-14H2,1-4H3,(H,27,31)