4-azanyl-1,3-dimethyl-6-[[4-(pyridin-4-ylmethyl)morpholin-2-yl]methylimino]-2-sulfanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-1,3-dimethyl-6-[[4-(pyridin-4-ylmethyl)morpholin-2-yl]methylimino]-2-sulfanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-amino-1,3-dimethyl-6-[[4-(4-pyridylmethyl)morpholin-2-yl]methylimino]-2-thioxo-pyrimidine-5-carbonitrile CAS Name: 4-amino-1,3-dimethyl-6-[[4-(pyridin-4-ylmethyl)-2-morpholinyl]methylimino]-2-sulfanylidene-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-1,3-dimethyl-6-[[4-(pyridin-4-ylmethyl)morpholin-2-yl]methylimino]-2-sulfanylidenepyrimidine-5-carbonitrile Traditional Name: 4-amino-1,3-dimethyl-6-[[4-(4-pyridylmethyl)morpholin-2-yl]methylimino]-2-thioxo-pyrimidine-5-carbonitrile Formula: C18H23N7OS MolecularWeight: 385.48652

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=NCC2CN(CCO2)CC3=CC=NC=C3)N(C1=S)C)C#N)N

Isomeric SMILES

CN1C(=C(C(=NCC2CN(CCO2)CC3=CC=NC=C3)N(C1=S)C)C#N)N

InChI

InChI=1S/C18H23N7OS/c1-23-16(20)15(9-19)17(24(2)18(23)27)22-10-14-12-25(7-8-26-14)11-13-3-5-21-6-4-13/h3-6,14H,7-8,10-12,20H2,1-2H3