[4-(5-butylpyrimidin-2-yl)phenyl]carbamodithioic acid

Systemtic Name: [4-(5-butylpyrimidin-2-yl)phenyl]carbamodithioic acid Openeye Name: [4-(5-butylpyrimidin-2-yl)phenyl]carbamodithioic acid CAS Name: [4-(5-butyl-2-pyrimidinyl)phenyl]carbamodithioic acid IUPAC Name: [4-(5-butylpyrimidin-2-yl)phenyl]carbamodithioic acid Traditional Name: [4-(5-butylpyrimidin-2-yl)phenyl]carbamodithioic acid Formula: C15H17N3S2 MolecularWeight: 303.44558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)NC(=S)S

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)NC(=S)S

InChI

InChI=1S/C15H17N3S2/c1-2-3-4-11-9-16-14(17-10-11)12-5-7-13(8-6-12)18-15(19)20/h5-10H,2-4H2,1H3,(H2,18,19,20)