1-methyl-3-[4-[(3-methylphenyl)amino]quinazolin-6-yl]-1-nitroso-urea

Systemtic Name: 1-methyl-3-[4-[(3-methylphenyl)amino]quinazolin-6-yl]-1-nitroso-urea Openeye Name: 1-methyl-3-[4-(3-methylanilino)quinazolin-6-yl]-1-nitroso-urea CAS Name: 1-methyl-3-[4-(3-methylanilino)-6-quinazolinyl]-1-nitrosourea IUPAC Name: 1-methyl-3-[4-(3-methylanilino)quinazolin-6-yl]-1-nitrosourea Traditional Name: 1-methyl-3-[4-(m-toluidino)quinazolin-6-yl]-1-nitroso-urea Formula: C17H16N6O2 MolecularWeight: 336.34794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)N(C)N=O

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)N(C)N=O

InChI

InChI=1S/C17H16N6O2/c1-11-4-3-5-12(8-11)20-16-14-9-13(21-17(24)23(2)22-25)6-7-15(14)18-10-19-16/h3-10H,1-2H3,(H,21,24)(H,18,19,20)