2-pyrrolidin-1-ylethyl N-phenyl-3,4-dihydro-1H-benzo[g]isoquinoline-2-carboximidothioate

Systemtic Name: 2-pyrrolidin-1-ylethyl N-phenyl-3,4-dihydro-1H-benzo[g]isoquinoline-2-carboximidothioate Openeye Name: 2-pyrrolidin-1-ylethyl N-phenyl-3,4-dihydro-1H-benzo[g]isoquinoline-2-carboximidothioate CAS Name: N-phenyl-3,4-dihydro-1H-benzo[g]isoquinoline-2-carboximidothioic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl N-phenyl-3,4-dihydro-1H-benzo[g]isoquinoline-2-carboximidothioate Traditional Name: N-phenyl-3,4-dihydro-1H-benz[g]isoquinoline-2-carboximidothioic acid 2-pyrrolidinoethyl ester Formula: C26H29N3S MolecularWeight: 415.59356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCSC(=NC2=CC=CC=C2)N3CCC4=CC5=CC=CC=C5C=C4C3

Isomeric SMILES

C1CCN(C1)CCSC(=NC2=CC=CC=C2)N3CCC4=CC5=CC=CC=C5C=C4C3

InChI

InChI=1S/C26H29N3S/c1-2-10-25(11-3-1)27-26(30-17-16-28-13-6-7-14-28)29-15-12-23-18-21-8-4-5-9-22(21)19-24(23)20-29/h1-5,8-11,18-19H,6-7,12-17,20H2