S-(naphthalen-1-ylmethyl) N-(6-chloranyl-2-methoxy-acridin-9-yl)-N-[4-(diethylamino)butan-2-yl]carbamothioate

Systemtic Name: S-(naphthalen-1-ylmethyl) N-(6-chloranyl-2-methoxy-acridin-9-yl)-N-[4-(diethylamino)butan-2-yl]carbamothioate Openeye Name: S-(1-naphthylmethyl) N-(6-chloro-2-methoxy-acridin-9-yl)-N-[3-(diethylamino)-1-methyl-propyl]carbamothioate CAS Name: N-(6-chloro-2-methoxy-9-acridinyl)-N-[4-(diethylamino)butan-2-yl]carbamothioic acid S-(1-naphthalenylmethyl) ester IUPAC Name: S-(naphthalen-1-ylmethyl) N-(6-chloro-2-methoxyacridin-9-yl)-N-[4-(diethylamino)butan-2-yl]carbamothioate Traditional Name: N-(6-chloro-2-methoxy-acridin-9-yl)-N-[3-(diethylamino)-1-methyl-propyl]thiocarbamic acid S-(1-naphthylmethyl) ester Formula: C34H36ClN3O2S MolecularWeight: 586.18654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(C)N(C1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC)C(=O)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCN(CC)CCC(C)N(C1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC)C(=O)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C34H36ClN3O2S/c1-5-37(6-2)19-18-23(3)38(34(39)41-22-25-12-9-11-24-10-7-8-13-28(24)25)33-29-16-14-26(35)20-32(29)36-31-17-15-27(40-4)21-30(31)33/h7-17,20-21,23H,5-6,18-19,22H2,1-4H3