1-[4-phenyl-6-(propylcarbamothioylamino)-1,3,5-triazin-2-yl]-3-propyl-thiourea

Systemtic Name: 1-[4-phenyl-6-(propylcarbamothioylamino)-1,3,5-triazin-2-yl]-3-propyl-thiourea Openeye Name: 1-[4-phenyl-6-(propylcarbamothioylamino)-1,3,5-triazin-2-yl]-3-propyl-thiourea CAS Name: 1-[4-phenyl-6-[[propylamino(sulfanylidene)methyl]amino]-1,3,5-triazin-2-yl]-3-propylthiourea IUPAC Name: 1-[4-phenyl-6-(propylcarbamothioylamino)-1,3,5-triazin-2-yl]-3-propylthiourea Traditional Name: 1-[4-phenyl-6-(propylthiocarbamoylamino)-s-triazin-2-yl]-3-propyl-thiourea Formula: C17H23N7S2 MolecularWeight: 389.54142

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=NC(=NC(=N1)C2=CC=CC=C2)NC(=S)NCCC

Isomeric SMILES

CCCNC(=S)NC1=NC(=NC(=N1)C2=CC=CC=C2)NC(=S)NCCC

InChI

InChI=1S/C17H23N7S2/c1-3-10-18-16(25)23-14-20-13(12-8-6-5-7-9-12)21-15(22-14)24-17(26)19-11-4-2/h5-9H,3-4,10-11H2,1-2H3,(H4,18,19,20,21,22,23,24,25,26)