(4S)-N,N-diethyl-6-methyl-4-[5-(3-nitrophenyl)furan-2-yl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4S)-N,N-diethyl-6-methyl-4-[5-(3-nitrophenyl)furan-2-yl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-N,N-diethyl-6-methyl-4-[5-(3-nitrophenyl)-2-furyl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-N,N-diethyl-6-methyl-4-[5-(3-nitrophenyl)-2-furanyl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-N,N-diethyl-6-methyl-4-[5-(3-nitrophenyl)furan-2-yl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-N,N-diethyl-6-methyl-4-[5-(3-nitrophenyl)-2-furyl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(NC(=S)NC1C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C(=O)C1=C(NC(=S)N[C@@H]1C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N4O4S/c1-4-23(5-2)19(25)17-12(3)21-20(29)22-18(17)16-10-9-15(28-16)13-7-6-8-14(11-13)24(26)27/h6-11,18H,4-5H2,1-3H3,(H2,21,22,29)/t18-/m1/s1