N-(phenylmethyl)-4-pyrido[2,3-d]pyrimidin-4-yl-piperazine-1-carbothioamide

Systemtic Name: N-(phenylmethyl)-4-pyrido[2,3-d]pyrimidin-4-yl-piperazine-1-carbothioamide Openeye Name: N-benzyl-4-pyrido[2,3-d]pyrimidin-4-yl-piperazine-1-carbothioamide CAS Name: N-(phenylmethyl)-4-(4-pyrido[2,3-d]pyrimidinyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-pyrido[2,3-d]pyrimidin-4-ylpiperazine-1-carbothioamide Traditional Name: N-benzyl-4-pyrido[2,3-d]pyrimidin-4-yl-piperazine-1-carbothioamide Formula: C19H20N6S MolecularWeight: 364.4673

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=CC=N3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=CC=N3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C19H20N6S/c26-19(21-13-15-5-2-1-3-6-15)25-11-9-24(10-12-25)18-16-7-4-8-20-17(16)22-14-23-18/h1-8,14H,9-13H2,(H,21,26)