1,1-bis(2-diethylaminoethyl)-3-(2-naphthalen-1-ylsulfanylethyl)-3-propan-2-yl-thiourea; ethanedioic acid

Systemtic Name: 1,1-bis(2-diethylaminoethyl)-3-(2-naphthalen-1-ylsulfanylethyl)-3-propan-2-yl-thiourea; ethanedioic acid Openeye Name: 1,1-bis(2-diethylaminoethyl)-3-isopropyl-3-[2-(1-naphthylsulfanyl)ethyl]thiourea; oxalic acid CAS Name: 1,1-bis(2-diethylaminoethyl)-3-[2-(1-naphthalenylthio)ethyl]-3-propan-2-ylthiourea; oxalic acid IUPAC Name: 1,1-bis(2-diethylaminoethyl)-3-(2-naphthalen-1-ylsulfanylethyl)-3-propan-2-ylthiourea; oxalic acid Traditional Name: 1,1-bis(2-diethylaminoethyl)-3-isopropyl-3-[2-(1-naphthylthio)ethyl]thiourea; oxalic acid Formula: C30H48N4O4S2 MolecularWeight: 592.85652

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CCN(CC)CC)C(=S)N(CCSC1=CC=CC2=CC=CC=C21)C(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CCN(CCN(CC)CC)C(=S)N(CCSC1=CC=CC2=CC=CC=C21)C(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C28H46N4S2.C2H2O4/c1-7-29(8-2)18-20-31(21-19-30(9-3)10-4)28(33)32(24(5)6)22-23-34-27-17-13-15-25-14-11-12-16-26(25)27;3-1(4)2(5)6/h11-17,24H,7-10,18-23H2,1-6H3;(H,3,4)(H,5,6)