N-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-N-[(Z)-3-[(E)-4-methyl-3-oxidanylidene-pent-1-enyl]sulfanyl-5-oxidanyl-pent-2-en-2-yl]methanamide

Systemtic Name: N-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-N-[(Z)-3-[(E)-4-methyl-3-oxidanylidene-pent-1-enyl]sulfanyl-5-oxidanyl-pent-2-en-2-yl]methanamide Openeye Name: N-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-N-[(Z)-4-hydroxy-1-methyl-2-[(E)-4-methyl-3-oxo-pent-1-enyl]sulfanyl-but-1-enyl]formamide CAS Name: N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-[(Z)-5-hydroxy-3-[[(E)-4-methyl-3-oxopent-1-enyl]thio]pent-2-en-2-yl]formamide IUPAC Name: N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[(Z)-5-hydroxy-3-[(E)-4-methyl-3-oxopent-1-enyl]sulfanylpent-2-en-2-yl]formamide Traditional Name: N-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-N-[(Z)-4-hydroxy-2-[[(E)-3-keto-4-methyl-pent-1-enyl]thio]-1-methyl-but-1-enyl]formamide Formula: C18H26N4O3S MolecularWeight: 378.48904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCO)SC=CC(=O)C(C)C)C

Isomeric SMILES

CC1=NC=C(C(=N1)N)CN(C=O)/C(=C(/CCO)\S/C=C/C(=O)C(C)C)/C

InChI

InChI=1S/C18H26N4O3S/c1-12(2)16(25)6-8-26-17(5-7-23)13(3)22(11-24)10-15-9-20-14(4)21-18(15)19/h6,8-9,11-12,23H,5,7,10H2,1-4H3,(H2,19,20,21)/b8-6+,17-13-