2-(1,3-benzothiazol-2-ylamino)-4-(4-methoxyphenyl)pyrimidine-5-carbonitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylamino)-4-(4-methoxyphenyl)pyrimidine-5-carbonitrile Openeye Name: 2-(1,3-benzothiazol-2-ylamino)-4-(4-methoxyphenyl)pyrimidine-5-carbonitrile CAS Name: 2-(1,3-benzothiazol-2-ylamino)-4-(4-methoxyphenyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylamino)-4-(4-methoxyphenyl)pyrimidine-5-carbonitrile Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-4-(4-methoxyphenyl)pyrimidine-5-carbonitrile Formula: C19H13N5OS MolecularWeight: 359.40442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H13N5OS/c1-25-14-8-6-12(7-9-14)17-13(10-20)11-21-18(23-17)24-19-22-15-4-2-3-5-16(15)26-19/h2-9,11H,1H3,(H,21,22,23,24)