6-bromanyl-3-[[5-[(E)-(4-dimethylaminophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]methylamino]-2-methyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[[5-[(E)-(4-dimethylaminophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]methylamino]-2-methyl-quinazolin-4-one Openeye Name: 6-bromo-3-[[5-[(E)-(4-dimethylaminophenyl)methyleneamino]-1,3,4-thiadiazol-2-yl]methylamino]-2-methyl-quinazolin-4-one CAS Name: 6-bromo-3-[[5-[(E)-(4-dimethylaminophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]methylamino]-2-methyl-4-quinazolinone IUPAC Name: 6-bromo-3-[[5-[(E)-(4-dimethylaminophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]methylamino]-2-methylquinazolin-4-one Traditional Name: 6-bromo-3-[[5-[(E)-[4-(dimethylamino)benzylidene]amino]-1,3,4-thiadiazol-2-yl]methylamino]-2-methyl-quinazolin-4-one Formula: C21H20BrN7OS MolecularWeight: 498.3988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=O)N1NCC3=NN=C(S3)N=CC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=O)N1NCC3=NN=C(S3)/N=C/C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C21H20BrN7OS/c1-13-25-18-9-6-15(22)10-17(18)20(30)29(13)24-12-19-26-27-21(31-19)23-11-14-4-7-16(8-5-14)28(2)3/h4-11,24H,12H2,1-3H3/b23-11+