1-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(1-benzylpiperidin-1-ium-4-ylidene)amino]thiourea CAS Name: 1-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(1-benzylpiperidin-1-ium-4-ylidene)amino]thiourea Formula: C16H23N4S+ MolecularWeight: 303.44562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=S)NN=C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H22N4S/c1-2-10-17-16(21)19-18-15-8-11-20(12-9-15)13-14-6-4-3-5-7-14/h2-7H,1,8-13H2,(H2,17,19,21)/p+1