[azanyl-[(6-methoxy-4-methyl-quinazolin-2-yl)amino]methylidene]-(phenylcarbamothioyl)azanium

Systemtic Name: [azanyl-[(6-methoxy-4-methyl-quinazolin-2-yl)amino]methylidene]-(phenylcarbamothioyl)azanium Openeye Name: [amino-[(6-methoxy-4-methyl-quinazolin-2-yl)amino]methylene]-(phenylcarbamothioyl)ammonium CAS Name: [amino-[(6-methoxy-4-methyl-2-quinazolinyl)amino]methylidene]-[anilino(sulfanylidene)methyl]ammonium IUPAC Name: [amino-[(6-methoxy-4-methylquinazolin-2-yl)amino]methylidene]-(phenylcarbamothioyl)azanium Traditional Name: [amino-[(6-methoxy-4-methyl-quinazolin-2-yl)amino]methylene]-(phenylthiocarbamoyl)ammonium Formula: C18H19N6OS+ MolecularWeight: 367.44806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)OC)NC(=[NH+]C(=S)NC3=CC=CC=C3)N

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)OC)NC(=[NH+]C(=S)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H18N6OS/c1-11-14-10-13(25-2)8-9-15(14)22-17(20-11)23-16(19)24-18(26)21-12-6-4-3-5-7-12/h3-10H,1-2H3,(H4,19,20,21,22,23,24,26)/p+1