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

Systemtic Name: 5-(2-azanylpyridin-4-yl)-N-cyclopropyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: 5-(2-amino-4-pyridyl)-N-cyclopropyl-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: 5-(2-amino-4-pyridinyl)-N-cyclopropyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: 5-(2-aminopyridin-4-yl)-N-cyclopropyl-3-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: [5-(2-amino-4-pyridyl)-3-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]-cyclopropyl-amine Formula: C20H18N6S MolecularWeight: 374.46212

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC3=C(C=CC=N3)C(=NC2C4=CC=CS4)C5=CC(=NC=C5)N

Isomeric SMILES

C1CC1NC2=NC3=C(C=CC=N3)C(=NC2C4=CC=CS4)C5=CC(=NC=C5)N

InChI

InChI=1S/C20H18N6S/c21-16-11-12(7-9-22-16)17-14-3-1-8-23-19(14)26-20(24-13-5-6-13)18(25-17)15-4-2-10-27-15/h1-4,7-11,13,18H,5-6H2,(H2,21,22)(H,23,24,26)