1-[2-chloranyl-4-(propylcarbamothioylamino)phenyl]-3-propyl-thiourea

Systemtic Name: 1-[2-chloranyl-4-(propylcarbamothioylamino)phenyl]-3-propyl-thiourea Openeye Name: 1-[2-chloro-4-(propylcarbamothioylamino)phenyl]-3-propyl-thiourea CAS Name: 1-[2-chloro-4-[[propylamino(sulfanylidene)methyl]amino]phenyl]-3-propylthiourea IUPAC Name: 1-[2-chloro-4-(propylcarbamothioylamino)phenyl]-3-propylthiourea Traditional Name: 1-[2-chloro-4-(propylthiocarbamoylamino)phenyl]-3-propyl-thiourea Formula: C14H21ClN4S2 MolecularWeight: 344.92634

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=CC(=C(C=C1)NC(=S)NCCC)Cl

Isomeric SMILES

CCCNC(=S)NC1=CC(=C(C=C1)NC(=S)NCCC)Cl

InChI

InChI=1S/C14H21ClN4S2/c1-3-7-16-13(20)18-10-5-6-12(11(15)9-10)19-14(21)17-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3,(H2,16,18,20)(H2,17,19,21)