(E)-N-[4-(1,3-benzothiazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]-4-oxidanylidene-pent-2-enamide

Systemtic Name: (E)-N-[4-(1,3-benzothiazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]-4-oxidanylidene-pent-2-enamide Openeye Name: (E)-N-[4-(1,3-benzothiazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]-4-oxo-pent-2-enamide CAS Name: (E)-N-[4-(1,3-benzothiazol-5-ylamino)-6-pyrido[3,4-d]pyrimidinyl]-4-oxo-2-pentenamide IUPAC Name: (E)-N-[4-(1,3-benzothiazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]-4-oxopent-2-enamide Traditional Name: (E)-N-[4-(1,3-benzothiazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]-4-keto-pent-2-enamide Formula: C19H14N6O2S MolecularWeight: 390.41846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC(=O)NC1=NC=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)SC=N4

Isomeric SMILES

CC(=O)/C=C/C(=O)NC1=NC=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)SC=N4

InChI

InChI=1S/C19H14N6O2S/c1-11(26)2-5-18(27)25-17-7-13-15(8-20-17)21-9-22-19(13)24-12-3-4-16-14(6-12)23-10-28-16/h2-10H,1H3,(H,20,25,27)(H,21,22,24)/b5-2+