4-azanyl-2-[2-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[2-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[2-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[2-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[2-keto-2-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethyl]thio]pyrimidine-5-carbonitrile Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(CCC2)C(=O)CSC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N(CCC2)C(=O)CSC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C17H17N5O2S/c1-24-13-4-5-14-11(7-13)3-2-6-22(14)15(23)10-25-17-20-9-12(8-18)16(19)21-17/h4-5,7,9H,2-3,6,10H2,1H3,(H2,19,20,21)