N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-[(1-methyl-5-indolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(1-methylindol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(1-methylindol-5-yl)sulfonyl-nipecotamide Formula: C27H34N4O3S MolecularWeight: 494.64886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H34N4O3S/c1-29-16-11-22-18-25(9-10-26(22)29)35(33,34)31-15-4-8-24(20-31)27(32)28-13-5-14-30-17-12-21-6-2-3-7-23(21)19-30/h2-3,6-7,9-11,16,18,24H,4-5,8,12-15,17,19-20H2,1H3,(H,28,32)