6-azanyl-5-phenylsulfanyl-1,3-dipropyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-phenylsulfanyl-1,3-dipropyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-phenylsulfanyl-1,3-dipropyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-(phenylthio)-1,3-dipropylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-phenylsulfanyl-1,3-dipropylpyrimidine-2,4-dione Traditional Name: 6-amino-5-(phenylthio)-1,3-dipropyl-pyrimidine-2,4-quinone Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)CCC)SC2=CC=CC=C2)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)CCC)SC2=CC=CC=C2)N

InChI

InChI=1S/C16H21N3O2S/c1-3-10-18-14(17)13(22-12-8-6-5-7-9-12)15(20)19(11-4-2)16(18)21/h5-9H,3-4,10-11,17H2,1-2H3