N,N-dimethyl-3-(6-thiophen-3-ylpyrido[2,3-b][1,4]benzodiazepin-11-yl)propan-1-amine

Systemtic Name: N,N-dimethyl-3-(6-thiophen-3-ylpyrido[2,3-b][1,4]benzodiazepin-11-yl)propan-1-amine Openeye Name: N,N-dimethyl-3-[6-(3-thienyl)pyrido[2,3-b][1,4]benzodiazepin-11-yl]propan-1-amine CAS Name: N,N-dimethyl-3-[6-(3-thiophenyl)-11-pyrido[2,3-b][1,4]benzodiazepinyl]-1-propanamine IUPAC Name: N,N-dimethyl-3-(6-thiophen-3-ylpyrido[2,3-b][1,4]benzodiazepin-11-yl)propan-1-amine Traditional Name: dimethyl-[3-[6-(3-thienyl)pyrido[2,3-b][1,4]benzodiazepin-11-yl]propyl]amine Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2C(=NC3=C1N=CC=C3)C4=CSC=C4

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2C(=NC3=C1N=CC=C3)C4=CSC=C4

InChI

InChI=1S/C21H22N4S/c1-24(2)12-6-13-25-19-9-4-3-7-17(19)20(16-10-14-26-15-16)23-18-8-5-11-22-21(18)25/h3-5,7-11,14-15H,6,12-13H2,1-2H3