N-cyclopropyl-5-(4-fluorophenyl)-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine

Systemtic Name: N-cyclopropyl-5-(4-fluorophenyl)-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: N-cyclopropyl-5-(4-fluorophenyl)-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: N-cyclopropyl-5-(4-fluorophenyl)-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: N-cyclopropyl-5-(4-fluorophenyl)-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: cyclopropyl-[5-(4-fluorophenyl)-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]amine Formula: C21H17FN4S MolecularWeight: 376.449883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC3=C(C=CC=N3)C(=NC2C4=CC=CS4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC1NC2=NC3=C(C=CC=N3)C(=NC2C4=CC=CS4)C5=CC=C(C=C5)F

InChI

InChI=1S/C21H17FN4S/c22-14-7-5-13(6-8-14)18-16-3-1-11-23-20(16)26-21(24-15-9-10-15)19(25-18)17-4-2-12-27-17/h1-8,11-12,15,19H,9-10H2,(H,23,24,26)