6-azanyl-5-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanoyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanoyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 5-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetyl]-6-amino-1-benzyl-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-1-oxoethyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-5-[2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]acetyl]-3-methylpyrimidine-2,4-dione Traditional Name: 5-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetyl]-6-amino-1-benzyl-3-methyl-pyrimidine-2,4-quinone Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)CN(CC=C)CC3=CC=C(S3)Cl

Isomeric SMILES

CN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)CN(CC=C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C22H23ClN4O3S/c1-3-11-26(13-16-9-10-18(23)31-16)14-17(28)19-20(24)27(22(30)25(2)21(19)29)12-15-7-5-4-6-8-15/h3-10H,1,11-14,24H2,2H3