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

Systemtic Name: N-cyclopropyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Openeye Name: N-cyclopropyl-3-(4-pyridyl)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine CAS Name: N-cyclopropyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine IUPAC Name: N-cyclopropyl-3-pyridin-4-yl-5-thiophen-2-yl-3H-pyrido[2,3-e][1,4]diazepin-2-amine Traditional Name: cyclopropyl-[3-(4-pyridyl)-5-(2-thienyl)-3H-pyrido[2,3-e][1,4]diazepin-2-yl]amine Formula: C20H17N5S MolecularWeight: 359.44748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC3=C(C=CC=N3)C(=NC2C4=CC=NC=C4)C5=CC=CS5

Isomeric SMILES

C1CC1NC2=NC3=C(C=CC=N3)C(=NC2C4=CC=NC=C4)C5=CC=CS5

InChI

InChI=1S/C20H17N5S/c1-3-15-18(16-4-2-12-26-16)24-17(13-7-10-21-11-8-13)20(23-14-5-6-14)25-19(15)22-9-1/h1-4,7-12,14,17H,5-6H2,(H,22,23,25)