1-[2-(2-azanyl-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)ethyl]-3-phenyl-thiourea

Systemtic Name: 1-[2-(2-azanyl-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)ethyl]-3-phenyl-thiourea Openeye Name: 1-[2-(2-amino-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)ethyl]-3-phenyl-thiourea CAS Name: 1-[2-(2-amino-3-cyano-1-pyrrolo[3,2-b]quinoxalinyl)ethyl]-3-phenylthiourea IUPAC Name: 1-[2-(2-amino-3-cyanopyrrolo[3,2-b]quinoxalin-1-yl)ethyl]-3-phenylthiourea Traditional Name: 1-[2-(2-amino-3-cyano-pyrrolo[3,2-b]quinoxalin-1-yl)ethyl]-3-phenyl-thiourea Formula: C20H17N7S MolecularWeight: 387.46088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

InChI

InChI=1S/C20H17N7S/c21-12-14-17-19(26-16-9-5-4-8-15(16)25-17)27(18(14)22)11-10-23-20(28)24-13-6-2-1-3-7-13/h1-9H,10-11,22H2,(H2,23,24,28)