N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCNC(=O)C1=CSC2=C1CCCC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)N(CCCNC(=O)C1=CSC2=C1CCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N2OS/c1-17(2)24(15-18-9-4-3-5-10-18)14-8-13-23-22(25)20-16-26-21-12-7-6-11-19(20)21/h3-5,9-10,16-17H,6-8,11-15H2,1-2H3,(H,23,25)