1-[3-[(7-chloranylquinolin-4-yl)amino]propyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[3-[(7-chloranylquinolin-4-yl)amino]propyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[3-[(7-chloro-4-quinolyl)amino]propyl]thiourea CAS Name: 1-[3-[(7-chloro-4-quinolinyl)amino]propyl]-3-prop-2-enylthiourea IUPAC Name: 1-[3-[(7-chloroquinolin-4-yl)amino]propyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[3-[(7-chloro-4-quinolyl)amino]propyl]thiourea Formula: C16H19ClN4S MolecularWeight: 334.86686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NCCCNC1=C2C=CC(=CC2=NC=C1)Cl

Isomeric SMILES

C=CCNC(=S)NCCCNC1=C2C=CC(=CC2=NC=C1)Cl

InChI

InChI=1S/C16H19ClN4S/c1-2-7-20-16(22)21-9-3-8-18-14-6-10-19-15-11-12(17)4-5-13(14)15/h2,4-6,10-11H,1,3,7-9H2,(H,18,19)(H2,20,21,22)