N-ethyl-5-phenyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine

Systemtic Name: N-ethyl-5-phenyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: N-ethyl-5-phenyl-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: N-ethyl-5-phenyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: N-ethyl-5-phenyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: ethyl-[5-phenyl-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]amine Formula: C20H18N4S MolecularWeight: 346.44872

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(C=CC=N2)C(=NC1C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CCNC1=NC2=C(C=CC=N2)C(=NC1C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N4S/c1-2-21-20-18(16-11-7-13-25-16)23-17(14-8-4-3-5-9-14)15-10-6-12-22-19(15)24-20/h3-13,18H,2H2,1H3,(H,21,22,24)