1-[2-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-6-yl]-3-(3-methoxyphenyl)urea

Systemtic Name: 1-[2-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-6-yl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[2-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-6-yl]-3-(3-methoxyphenyl)urea CAS Name: 1-[2-[(6,7-dimethoxy-4-quinazolinyl)amino]-1,3-benzothiazol-6-yl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[2-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-6-yl]-3-(3-methoxyphenyl)urea Traditional Name: 1-[2-[(6,7-dimethoxyquinazolin-4-yl)amino]-1,3-benzothiazol-6-yl]-3-(3-methoxyphenyl)urea Formula: C25H22N6O4S MolecularWeight: 502.54498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2=CC3=C(C=C2)N=C(S3)NC4=NC=NC5=CC(=C(C=C54)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC2=CC3=C(C=C2)N=C(S3)NC4=NC=NC5=CC(=C(C=C54)OC)OC

InChI

InChI=1S/C25H22N6O4S/c1-33-16-6-4-5-14(9-16)28-24(32)29-15-7-8-18-22(10-15)36-25(30-18)31-23-17-11-20(34-2)21(35-3)12-19(17)26-13-27-23/h4-13H,1-3H3,(H2,28,29,32)(H,26,27,30,31)