2-cyclopentyl-N-[3-[cyclopentylmethyl(furan-2-yl)amino]propyl]-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-cyclopentyl-N-[3-[cyclopentylmethyl(furan-2-yl)amino]propyl]-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclopentyl-N-[3-[cyclopentylmethyl(2-furyl)amino]propyl]-1-oxo-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclopentyl-N-[3-[cyclopentylmethyl(2-furanyl)amino]propyl]-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclopentyl-N-[3-[cyclopentylmethyl(furan-2-yl)amino]propyl]-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopentyl-N-[3-[cyclopentylmethyl(2-furyl)amino]propyl]-1-keto-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C32H39N3O3S MolecularWeight: 545.73536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN(CCCNC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CCCC4)C5=CC=CS5)C6=CC=CO6

Isomeric SMILES

C1CCC(C1)CN(CCCNC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CCCC4)C5=CC=CS5)C6=CC=CO6

InChI

InChI=1S/C32H39N3O3S/c36-31(33-18-9-19-34(28-17-7-20-38-28)22-23-10-1-2-11-23)29-25-14-5-6-15-26(25)32(37)35(24-12-3-4-13-24)30(29)27-16-8-21-39-27/h5-8,14-17,20-21,23-24,29-30H,1-4,9-13,18-19,22H2,(H,33,36)