ethyl 2-oxidanylidene-4-(piperazin-1-ylmethyl)-3-prop-2-enyl-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-4-(piperazin-1-ylmethyl)-3-prop-2-enyl-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-2-oxo-4-(piperazin-1-ylmethyl)-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 2-oxo-4-(1-piperazinylmethyl)-3-prop-2-enyl-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-4-(piperazin-1-ylmethyl)-3-prop-2-enyl-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-2-keto-4-(piperazinomethyl)-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CSC=C2)CC=C)CN3CCNCC3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CSC=C2)CC=C)CN3CCNCC3

InChI

InChI=1S/C19H26N4O3S/c1-3-8-23-15(12-22-9-6-20-7-10-22)16(18(24)26-4-2)17(21-19(23)25)14-5-11-27-13-14/h3,5,11,13,17,20H,1,4,6-10,12H2,2H3,(H,21,25)