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

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(1-benzylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-prop-2-enylthiourea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(1-benzylpiperidin-1-ium-4-yl)thiourea Formula: C16H24N3S+ MolecularWeight: 290.44686

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H23N3S/c1-2-10-17-16(20)18-15-8-11-19(12-9-15)13-14-6-4-3-5-7-14/h2-7,15H,1,8-13H2,(H2,17,18,20)/p+1