N-[2-azanyl-5-(4-cyanophenyl)-3H-1,4-benzodiazepin-9-yl]ethanamide

Systemtic Name: N-[2-azanyl-5-(4-cyanophenyl)-3H-1,4-benzodiazepin-9-yl]ethanamide Openeye Name: N-[2-amino-5-(4-cyanophenyl)-3H-1,4-benzodiazepin-9-yl]acetamide CAS Name: N-[2-amino-5-(4-cyanophenyl)-3H-1,4-benzodiazepin-9-yl]acetamide IUPAC Name: N-[2-amino-5-(4-cyanophenyl)-3H-1,4-benzodiazepin-9-yl]acetamide Traditional Name: N-[2-amino-5-(4-cyanophenyl)-3H-1,4-benzodiazepin-9-yl]acetamide Formula: C18H15N5O MolecularWeight: 317.3446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC2=C1N=C(CN=C2C3=CC=C(C=C3)C#N)N

Isomeric SMILES

CC(=O)NC1=CC=CC2=C1N=C(CN=C2C3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C18H15N5O/c1-11(24)22-15-4-2-3-14-17(21-10-16(20)23-18(14)15)13-7-5-12(9-19)6-8-13/h2-8H,10H2,1H3,(H2,20,23)(H,22,24)